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Butalbital 2TMS
SpectraBase Compound ID 3HbEm592bDF
InChI InChI=1S/C17H32N2O3Si2/c1-10-11-17(12-13(2)3)14(20)18(23(4,5)6)16(22)19(15(17)21)24(7,8)9/h10,13H,1,11-12H2,2-9H3
InChIKey FCSOKCNDOOWRJV-UHFFFAOYSA-N
Mol Weight 368.6 g/mol
Molecular Formula C17H32N2O3Si2
Exact Mass 368.195146 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 2n3pERT9I6S
Name Butalbital 2TMS
CAS Registry Number 52937-70-9
Classification Pharmaceutical drug derivative
Copyright Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved.
DEA Citation 21 CFR §1308.13 (c) (3)
DEA Controlled Substance Form Any compound, mixture or preparation
DEA Controlled Substance Name Barbituric acid derivatives
DEA Controlled Substance Type Salts, isomers, derivatives and salts of isomers and derivatives
DEA Controlled Substances Code Number 2100
DEA Schedule Schedule III
DEA Section Depressants. Unless specifically excepted or unless listed in another schedule, any material, compound, mixture, or preparation which contains any quantity of the following substances having a depressant effect on the central nervous system
Exact Mass 368.195145965 u
Formula C17H32N2O3Si2
InChI InChI=1S/C17H32N2O3Si2/c1-10-11-17(12-13(2)3)14(20)18(23(4,5)6)16(22)19(15(17)21)24(7,8)9/h10,13H,1,11-12H2,2-9H3
InChIKey FCSOKCNDOOWRJV-UHFFFAOYSA-N
Ionization Type Electron Ionization (EI)
Molecular Weight 368.624 g/mol
Nominal Mass 368 u
Quality 965
Retention Index 2678
SMILES C1(C(N(C(N(C1=O)[Si](C)(C)C)=O)[Si](C)(C)C)=O)(CC(C)C)CC=C
SPLASH splash10-0w29-3439000000-d1e6076ee57dc3469df7
Source of Spectrum DigiLab GmbH (C) 2024
Synonyms 5-(2-methylpropyl)-5-(prop-2-en-1-yl)-1,3-bis(trimethylsilyl)-1,3-diazinane-2,4,6-trione
Technique GC/MS
Wiley ID DD2024_025629